Summary

IMPPAT Phytochemical identifier: IMPHY012695

Phytochemical name: Euglobal Ia1

Synonymous chemical names:
euglobal ia1

External chemical identifiers:
CID:3530567

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Chemical structure information

SMILES:
O=Cc1c(O)c(C=O)c2c(c1O)C(CC(C)C)C1C(O2)(C)C=CC(C1)C(C)C

InChI:
InChI=1S/C23H30O5/c1-12(2)8-15-18-9-14(13(3)4)6-7-23(18,5)28-22-17(11-25)20(26)16(10-24)21(27)19(15)22/h6-7,10-15,18,26-27H,8-9H2,1-5H3

InChIKey:
GCAXPYWXIWWHHT-UHFFFAOYSA-N

DeepSMILES:
O=CccO)cC=O))ccc6O))CCCC)C)))CCO6)C)C=CCC6)CC)C

Functional groups:
CC=CC, cC=O, cO, cOC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CC2Oc3ccccc3CC2CC1

Scaffold Graph/Node level:
C1CCC2OC3CCCCC3CC2C1

Scaffold Graph level:
C1CCC2CC3CCCCC3CC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Benzopyrans

ClassyFire Subclass: 1-benzopyrans

NP Classifier Biosynthetic pathway: Polyketides, Terpenoids

NP Classifier Superclass: Phloroglucinols

NP Classifier Class: Phloroglucinol-terpene hybrids

NP-Likeness score: 2.466

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Chemical structure download